Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 7/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL692451 | 0.89 | NPC1 (0.37) | ALDH1A1NPC1TP53RAB9ASMN1; SMN2 | |
| SCHEMBL1781135 | 0.86 | PIK3CG (0.39) | ALDH1A1NPC1TP53RAB9ASMN1; SMN2 | |
| SCHEMBL1770958 | 0.85 | ABL1 (0.34) | ALDH1A1NPC1TP53RAB9ASMN1; SMN2 | |
| SCHEMBL1781491 | 0.79 | PIK3CG (0.42) | ALDH1A1NPC1TP53RAB9ASMN1; SMN2 | |
| SCHEMBL1770081 | 0.79 | PI4KA (0.32) | ALDH1A1NPC1TP53RAB9ASMN1; SMN2 | |
| SCHEMBL1782049 | 0.78 | PIK3CG (0.38) | ALDH1A1NPC1TP53RAB9ASMN1; SMN2 | |
| SCHEMBL2671947 | 0.78 | PI4KB (0.36) | ALDH1A1LMNAGAAMAPTHPGD | |
| SCHEMBL1783223 | 0.78 | OGA (0.42) | ALDH1A1NPC1TP53RAB9ASMN1; SMN2 | |
| SCHEMBL13690398 | 0.78 | PIK3CA (0.43) | LMNAGAAMAPTHPGDPIK3CG | |
| SCHEMBL1781217 | 0.78 | PIK3CG (0.43) | ALDH1A1NPC1RAB9ASMN1; SMN2POLB |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2421871-A1 | THIA-TRIAZA-CYCLOPENTAZULENES AS PI3-KINASES INHIBITORS FOR THE TREATMENT OF CANCER | Boehringer Ingelheim International GmbH (DE) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010122071-A1 | THIA-TRIAZA-CYCLOPENTAZULENES AS PI3-KINASES INHIBITORS FOR THE TREATMENT OF CANCER | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-10-28 | — | — | WO | disclosed |